Information card for entry 4060763

Structure parameters

• Formula: C36 H62 N Si3 Y
• Calculated formula: C36 H62 N Si3 Y
• SMILES: [Y]123456789(N([Si](C)(C)C)[Si](C)(C)C)[c]%10([Si](C)(C)[c]%115[cH]6[cH]7[c]8([cH]9%11)[C@@H]5C[C@@H](CC[C@H]5C(C)C)C)[c]51[c]2([c]13[c]4%10CCCC1)CCCC5
• Title of publication: "Widening the Roof": Synthesis and Characterization of New Chiral C1-Symmetric Octahydrofluorenyl Organolanthanide Catalysts and Their Implementation in the Stereoselective Cyclizations of Aminoalkenes and Phosphinoalkenes
• Authors of publication: Michael R. Douglass; Masamichi Ogasawara; Sukwon Hong; Matthew V. Metz; Tobin J. Marks
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Pages of publication: 283 - 292
• a: 9.7969 ± 0.0008 Å
• b: 19.075 ± 0.002 Å
• c: 20.09 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3754.3 ± 0.8 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0307
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.056
• Weighted residual factors for all reflections included in the refinement: 0.0574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No